5-[(S)-[(2S,5R)-2,5-dimethyl-4-prop-2-enyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]-N-ethyl-pyridine-3-carboxamide

Systemtic Name: 5-[(S)-[(2S,5R)-2,5-dimethyl-4-prop-2-enyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]-N-ethyl-pyridine-3-carboxamide Openeye Name: 5-[(S)-[(2S,5R)-4-allyl-2,5-dimethyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]-N-ethyl-pyridine-3-carboxamide CAS Name: 5-[(S)-[(2S,5R)-2,5-dimethyl-4-prop-2-enyl-1-piperazinyl]-(3-hydroxyphenyl)methyl]-N-ethyl-3-pyridinecarboxamide IUPAC Name: 5-[(S)-[(2S,5R)-2,5-dimethyl-4-prop-2-enylpiperazin-1-yl]-(3-hydroxyphenyl)methyl]-N-ethylpyridine-3-carboxamide Traditional Name: 5-[(S)-[(2S,5R)-4-allyl-2,5-dimethyl-piperazino]-(3-hydroxyphenyl)methyl]-N-ethyl-nicotinamide Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CN=C1)C(C2=CC(=CC=C2)O)N3CC(N(CC3C)CC=C)C

Isomeric SMILES

CCNC(=O)C1=CC(=CN=C1)[C@H](C2=CC(=CC=C2)O)N3C[C@H](N(C[C@@H]3C)CC=C)C

InChI

InChI=1S/C24H32N4O2/c1-5-10-27-15-18(4)28(16-17(27)3)23(19-8-7-9-22(29)12-19)20-11-21(14-25-13-20)24(30)26-6-2/h5,7-9,11-14,17-18,23,29H,1,6,10,15-16H2,2-4H3,(H,26,30)/t17-,18+,23+/m1/s1